3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 3-(3-oxopiperazin-1-yl)sulfonyl-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 3-[(3-oxo-1-piperazinyl)sulfonyl]-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 3-(3-oxopiperazin-1-yl)sulfonyl-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: N-(5-amyl-1,3,4-thiadiazol-2-yl)-3-(3-ketopiperazino)sulfonyl-benzamide Formula: C18H23N5O4S2 MolecularWeight: 437.53632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(S1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCNC(=O)C3

Isomeric SMILES

CCCCCC1=NN=C(S1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCNC(=O)C3

InChI

InChI=1S/C18H23N5O4S2/c1-2-3-4-8-16-21-22-18(28-16)20-17(25)13-6-5-7-14(11-13)29(26,27)23-10-9-19-15(24)12-23/h5-7,11H,2-4,8-10,12H2,1H3,(H,19,24)(H,20,22,25)